/tools/maxsmi
maxsmi
volkamerlab/maxsmi
summary
Maxsmi is a tool designed for data augmentation in molecular property prediction using deep learning techniques. It provides various strategies for augmenting SMILES representations to enhance the accuracy of predictions for molecular properties and activities.
description
maxsmi: a guide to SMILES augmentation. Find the optimal SMILES augmentation for accurate molecular prediction.
topics
deep-learningcheminformaticsdata-augmentation
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